5-chloranyl-2-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-isoindole

Systemtic Name: 5-chloranyl-2-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-isoindole Openeye Name: 2-(4-benzylpiperazin-1-yl)sulfonyl-5-chloro-isoindole CAS Name: 5-chloro-2-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]isoindole IUPAC Name: 2-(4-benzylpiperazin-1-yl)sulfonyl-5-chloroisoindole Traditional Name: 2-(4-benzylpiperazino)sulfonyl-5-chloro-isoindole Formula: C19H20ClN3O2S MolecularWeight: 389.899

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)N3C=C4C=CC(=CC4=C3)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)N3C=C4C=CC(=CC4=C3)Cl

InChI

InChI=1S/C19H20ClN3O2S/c20-19-7-6-17-14-23(15-18(17)12-19)26(24,25)22-10-8-21(9-11-22)13-16-4-2-1-3-5-16/h1-7,12,14-15H,8-11,13H2